COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK844490
Chemical Name: ethyl2-({(E)-2-cyano-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate
Smiles: CCOC(=O)c1ccccc1N/C=C(/c1scc(n1)c1cccc(c1)[N+](=O)[O-])\C#N

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Molecular Weight: 420.45
Empirical Formula: C21H16N4O4S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.511
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 149
Number of rings: 3

     

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